[phenixbb] automr wizard: searching for all plausible space groups option

Vitali Stanevich stanevich at wisc.edu
Wed Dec 7 21:05:34 PST 2011


I'm trying to solve structure by MR with phenix 1.6.1-357 version. I have
100% identity search model and can find solution without problem in ccp4i
in P212121 sg. But, I can't do it in phenix.automr command line because
program looks only for P222 space group (pointed out by Randy Read). I use
.sca from hkl2000 and running program from parameters file. I tried:

all_plausible_sg_list = True
use_all_plausible_sg = True
all_plausible_sg_list = P222 P2221 P21212 P212121
use_all_plausible_sg = True
space_group = "P 21 21 21"

They lead to report that no solution found or program being stalled (last
variant). What should I do to make phaser search for all space groups in
P222 point group?

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